N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-phenylmethoxy-benzamide

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-phenylmethoxybenzamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzamide Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O2S/c1-16-7-12-20-21(14-25)24(29-22(20)13-16)26-23(27)18-8-10-19(11-9-18)28-15-17-5-3-2-4-6-17/h2-6,8-11,16H,7,12-13,15H2,1H3,(H,26,27)